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88795-87-3,MFCD00461576
Catalog No.:AA004AQY

88795-87-3 | 1-(2,2-Dimethyltetrahydro-2H-pyran-4-yl)pentan-1-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$40.00   $28.00
- +
5g
95%
in stock  
$161.00   $113.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA004AQY
Chemical Name:
1-(2,2-Dimethyltetrahydro-2H-pyran-4-yl)pentan-1-one
CAS Number:
88795-87-3
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
MDL Number:
MFCD00461576
SMILES:
CCCCC(=O)C1CCOC(C1)(C)C
Properties
Computed Properties
 
Complexity:
197  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.2  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:88795-87-3 Molecular Formula|88795-87-3 MDL|88795-87-3 SMILES|88795-87-3 1-(2,2-Dimethyltetrahydro-2H-pyran-4-yl)pentan-1-one
Catalog No.: AA004AQY
88795-87-3,MFCD00461576
88795-87-3 | 1-(2,2-Dimethyltetrahydro-2H-pyran-4-yl)pentan-1-one
Pack Size： 1g
Purity： 95%
in stock
$40.00 $28.00
Pack Size： 5g
Purity： 95%
in stock
$161.00 $113.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA004AQY
Chemical Name: 1-(2,2-Dimethyltetrahydro-2H-pyran-4-yl)pentan-1-one
CAS Number: 88795-87-3
Molecular Formula: C12H22O2
Molecular Weight: 198.3019
MDL Number: MFCD00461576
SMILES: CCCCC(=O)C1CCOC(C1)(C)C
Properties
Complexity: 197  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.2  
Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

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